1-[(2Z)-2-ethylideneheptyl]-1-methyl-piperazin-1-ium; 2,2,2-tris(fluoranyl)ethanoate

Systemtic Name: 1-[(2Z)-2-ethylideneheptyl]-1-methyl-piperazin-1-ium; 2,2,2-tris(fluoranyl)ethanoate Openeye Name: 1-[(2Z)-2-ethylideneheptyl]-1-methyl-piperazin-1-ium; 2,2,2-trifluoroacetate CAS Name: 1-[(2Z)-2-ethylideneheptyl]-1-methylpiperazin-1-ium; 2,2,2-trifluoroacetate IUPAC Name: 1-[(2Z)-2-ethylideneheptyl]-1-methylpiperazin-1-ium; 2,2,2-trifluoroacetate Traditional Name: 1-[(Z)-2-amylbut-2-enyl]-1-methyl-piperazin-1-ium; 2,2,2-trifluoroacetate Formula: C16H29F3N2O2 MolecularWeight: 338.40887

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=CC)C[N+]1(CCNCC1)C.C(=O)(C(F)(F)F)[O-]

Isomeric SMILES

CCCCC/C(=C/C)/C[N+]1(CCNCC1)C.C(=O)(C(F)(F)F)[O-]

InChI

InChI=1S/C14H29N2.C2HF3O2/c1-4-6-7-8-14(5-2)13-16(3)11-9-15-10-12-16;3-2(4,5)1(6)7/h5,15H,4,6-13H2,1-3H3;(H,6,7)/q+1;/p-1/b14-5-;